Geometry & MOs

Info

ID:	353671
PubChem CID:	127285248
Reduced:	O2N6C15H22 (1)
Stoich.:	A2B6C15D22 (1)
Weight, g/mol:	358.200491
ΔH_f, kcal/mol:	-34.23
Dipole, Da:	2.58
IP(EA), eV:	-8.99(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-3-oxopiperazin-1-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1CC(=O)N2CCN(CC2)C3=NC=CN=C3

DOS

IR

Vibrations